SCHEMBL7304909

SCHEMBL7304909

Cc1cc(C2=NNC(=O)CC2)ccc1OCCCNCC(O)COc1ccc(CCOCC(C)C)cc1

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.43
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
ADRB2 P07550 3/20 0.40
ADRB3 P13945 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7305660 0.98 MAPT (0.44) MAPTKMT2ALMNANPY1RNPY2R
SCHEMBL7302226 0.91 LMNA (0.48) KMT2ALMNANPY1RNPY2RADRB2
SCHEMBL7304907 0.90 KMT2A (0.44) MAPTKMT2ALMNANPY1RNPY2R
SCHEMBL7296328 0.89 LMNA (0.47) KMT2ALMNANPY1RNPY2RADRB2
SCHEMBL7296572 0.88 ADRB1 (0.49) KMT2ALMNAADRB2ADRB3
SCHEMBL9686910 0.88 ADRB2 (0.47) MAPTKMT2ALMNANPY1RNPY2R
SCHEMBL7299736 0.86 KMT2A (0.45) MAPTKMT2ALMNANPY1RNPY2R
SCHEMBL7303245 0.85 ADRB2 (0.48) MAPTKMT2ALMNANPY1RNPY2R
SCHEMBL7297332 0.85 LMNA (0.47) MAPTKMT2ALMNANPY1RNPY2R
SCHEMBL8262868 0.84 ADRB2 (0.46) KMT2ALMNANPY1RNPY2RADRB2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5135932-A 2-HYDROXYPROPYLAMINO-ALKYL-BENZIMIDAZOLY-5-YL DERIVATIVES AND THEIR USE IN THE TREATMENT OF HEART DISEASE DR. KARL THOMAE GMBH (DE) 1992-08-04 US disclosed
EP-0400519-A1 2-Hydroxy-n-propylamines, medicaments containing these compounds and method for preparing them Dr. Karl Thomae GmbH (DE) 1990-12-05 EP disclosed